N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloranylpyridazin-3-yl)-N-ethyl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloranylpyridazin-3-yl)-N-ethyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloropyridazin-3-yl)-N-ethyl-piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloro-3-pyridazinyl)-N-ethyl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloropyridazin-3-yl)-N-ethylpiperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-ethyl-N-piperonyl-nipecotamide Formula: C20H23ClN4O3 MolecularWeight: 402.87462

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCCN(C3)C4=NN=C(C=C4)Cl

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCCN(C3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C20H23ClN4O3/c1-2-24(11-14-5-6-16-17(10-14)28-13-27-16)20(26)15-4-3-9-25(12-15)19-8-7-18(21)22-23-19/h5-8,10,15H,2-4,9,11-13H2,1H3